2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol

C15H16O2 — CID 66843449

IUPAC2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol
SMILESCc1ccc(Cc2cccc(C)c2O)cc1O
InChIInChI=1S/C15H16O2/c1-10-6-7-12(9-14(10)16)8-13-5-3-4-11(2)15(13)17/h3-7,9,16-17H,8H2,1-2H3
InChIKeyHPTUWRSSQXIDOS-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.31
Rot. Bonds2

About 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol

2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol (PubChem CID 66843449) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol.

Molecular Properties

Compound Name2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol
PubChem CID66843449
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol
SMILESCc1ccc(Cc2cccc(C)c2O)cc1O
InChIInChI=1S/C15H16O2/c1-10-6-7-12(9-14(10)16)8-13-5-3-4-11(2)15(13)17/h3-7,9,16-17H,8H2,1-2H3
InChIKeyHPTUWRSSQXIDOS-UHFFFAOYSA-N
XLogP3.31
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-6-methylphenol;5-ethyl-2-methylphenol
CID 158425788
2-[(2-hydroxy-3-methylphenyl)methyl]-6-methylphenol
CID 164967326
4-[(2-hydroxy-3-methylphenyl)methyl]-2,6-dimethylphenol
CID 22278094
2-[(4-hydroxyphenyl)methyl]-6-methylphenol
CID 91146240
2-[[2-hydroxy-3-[(2-hydroxy-3-methylphenyl)methyl]phenyl]methyl]-6-methylphenol
CID 20768179
2-[(3-hydroxy-4-methylphenyl)methyl]benzaldehyde
CID 143183136
2-[(3-hydroxy-4-methylphenyl)methyl]-4-methylphenol
CID 143552541
4-[[2-hydroxy-4-[(3-hydroxy-4-methylphenyl)methyl]-5-methylphenyl]methyl]-2,6-dimethylphenol
CID 162507971
ethene;2-[(3-hydroxy-4-methylphenyl)methyl]benzaldehyde
CID 143183135
5-[2-(3-hydroxy-4-methylphenyl)ethyl]-2-methylphenol
CID 138664749
5-[(4-ethylphenyl)methyl]-2-methylphenol
CID 54074755
3-[(2-hydroxy-3-methylphenyl)methyl]-6-[(3-hydroxy-2-methylphenyl)methyl]-2-methylphenol
CID 54300976

Frequently Asked Questions

What is the IUPAC name of 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol?
The IUPAC name of 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol (CID 66843449) is 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol.
What is the SMILES notation for 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol?
The canonical SMILES for 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol is Cc1ccc(Cc2cccc(C)c2O)cc1O.
What is the InChIKey of 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol?
The InChIKey is HPTUWRSSQXIDOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-10-6-7-12(9-14(10)16)8-13-5-3-4-11(2)15(13)17/h3-7,9,16-17H,8H2,1-2H3.
What are the key properties of 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol?
2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol has a molecular weight of 228.29 g/mol, XLogP of 3.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-hydroxy-4-methylphenyl)methyl]-6-methylphenol is sourced from PubChem (CID 66843449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).